Vitas-M small molecule compound

7-chloro-5'-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-6'-hydroxy-4,6-dimethoxy-1',3',8'-trimethyl-1',5',8',9'-tetrahydro-2'H,3H-spiro[1-benzofuran-2,7'-pyrimido[4,5-b]quinoline]-2',3,4'(3'H)-trione

Catalog ID
STL549731
SMILES COc1cc(OC)c(c2c1C(=O)C1(O2)C(C)CC2=Nc3c(C(C2=C1O)c1ccc2c(c1)n(C)c(=O)n2C)c(=O)n(c(=O)n3C)C)Cl

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C32H30ClN5O8 MW 648.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30ClN5O8/c1-13-10-15-21(26(39)32(13)27(40)22-18(44-6)12-19(45-7)24(33)25(22)46-32)20(23-28(34-15)37(4)31(43)38(5)29(23)41)14-8-9-16-17(11-14)36(3)30(42)35(16)2/h8-9,11-13,20,39H,10H2,1-7H3
InChIKey
HAPZVIXIQBNXJT-UHFFFAOYSA-N
Synonyms

7chloro5(13dimethyl2oxo23dihydro1Hbenzimidazol5yl)6hydroxy46dimethoxy138trimethyl1589tetrahydro2H3Hspiro(1benzofuran27pyrimido(45b)quinoline)234(3H)trione
InChI=1SC32H30ClN5O8c113101521(26(39)32(13)27(40)2218(446)1219(457)24(33)25(22)4632)20(2328(3415)37(4)31(43)38(5)29(23)41)14891617(1114)36(3)30(42)35(16)2h8911132039H10H217H3
MFCD31757168
ZINC000888089079
ZINC000888089082

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Available files

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